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Chromium, [bis(1-methyl-3-oxo-1-butenyl) phenylphosphonite-P]pentacarbonyl-, (OC-6-22)-
SpectraBase Compound ID JIQT1Ty3CvW
InChI InChI=1S/C16H19O4P.5CO.Cr/c1-12(17)10-14(3)19-21(16-8-6-5-7-9-16)20-15(4)11-13(2)18;5*1-2;/h5-11H,1-4H3;;;;;;/b14-10+,15-11+;;;;;;
InChIKey ZWQCMRIUKPOQKE-ZRNDMYTASA-N
Mol Weight 498.34 g/mol
Molecular Formula C21H19CrO9P
Exact Mass 498.017174 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6jTsyaPXHVM
Name Chromium, [bis(1-methyl-3-oxo-1-butenyl) phenylphosphonite-P]pentacarbonyl-, (OC-6-22)-
Alternate Name(s) Pentacarbonyl(bis(1-methyl-3-oxo-1-butenyloxy)phenylphosphen)chrome Phosphonous acid, phenyl-, bis(1-methyl-3-oxo-1-butenyl) ester, chromium complex
CAS Registry Number 72344-90-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H19CrO9P
InChI InChI=1S/C16H19O4P.5CO.Cr/c1-12(17)10-14(3)19-21(16-8-6-5-7-9-16)20-15(4)11-13(2)18;5*1-2;/h5-11H,1-4H3;;;;;;/b14-10+,15-11+;;;;;;
InChIKey ZWQCMRIUKPOQKE-ZRNDMYTASA-N
Molecular Weight 498.344 g/mol
SMILES C(\C=C/(O[P-]([Cr+](C#[O])(C#[O])(C#[O])(C#[O])C#[O])(O\C(=C\C(=O)C)C)c1ccccc1)C)(=O)C
SPLASH splash10-0a4i-0019200000-656f323fa1ff4ad8a2c5
Source of Spectrum K-112-3643-0
Wiley ID 1398487